Cefotiam hexetil hydrochloride
CAS Registry Number®
95789-30-3
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CAS Name
Cefotiam hexetil hydrochlorideMolecular Formula
C27H37N9O7S3.2ClHCite this Page
Cefotiam hexetil hydrochloride. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=95789-30-3 (retrieved ) (CAS RN: 95789-30-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C27H37N9O7S3.2ClH/c1-15(42-27(40)43-18-7-5-4-6-8-18)41-24(39)21-16(13-46-26-31-32-33-35(26)10-9-34(2)3)12-44-23-20(22(38)36(21)23)30-19(37)11-17-14-45-25(28)29-17;;/h14-15,18,20,23H,4-13H2,1-3H3,(H2,28,29)(H,30,37);2*1H/t15?,20-,23-;;/m1../s1
InChIKey
InChIKey=FFSANQNELHESQJ-LWBICVDYSA-N
SMILES
C(OC(OC(OC1CCCCC1)=O)C)(=O)C=2N3[C@@]([C@H](NC(CC=4N=C(N)SC4)=O)C3=O)(SCC2CSC=5N(CCN(C)C)N=NN5)[H].Cl
Canonical SMILES
Cl.O=C(OC(OC(=O)C1=C(CSC2=NN=NN2CCN(C)C)CSC3N1C(=O)C3NC(=O)CC=4N=C(SC4)N)C)OC5CCCCC5
Other Names for this Substance
- 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[2-(2-amino-4-thiazolyl)acetyl]amino]-3-[[[1-[2-(dimethylamino)ethyl]-1H-tetrazol-5-yl]thio]methyl]-8-oxo-, 1-[[(cyclohexyloxy)carbonyl]oxy]ethyl ester, hydrochloride (1:2), (6R,7R)-
- 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)acetyl]amino]-3-[[[1-[2-(dimethylamino)ethyl]-1H-tetrazol-5-yl]thio]methyl]-8-oxo-, 1-[[(cyclohexyloxy)carbonyl]oxy]ethyl ester, dihydrochloride, [6R-(6α,7β)]-
- 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)acetyl]amino]-3-[[[1-[2-(dimethylamino)ethyl]-1H-tetrazol-5-yl]thio]methyl]-8-oxo-, 1-[[(cyclohexyloxy)carbonyl]oxy]ethyl ester, dihydrochloride, (6R,7R)-
- Cefotiam hexetil hydrochloride
- SCE 2174
Deleted or Replaced CAS Registry Numbers
132441-51-1
